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[5-(4-fluoro-3-trifluoromethyl-phenyl)-2-methyl-2H-pyrazol-3-yl]-methanol

HCID 69280241
NotesReactions
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Substructure searchFind similar structures

Basic information

Standard SMILES
Cn1nc(-c2ccc(F)c(C(F)(F)F)c2)cc1CO
InChIKey
GOAXUSZMVXOUJT-UHFFFAOYSA-N
Molecular formula
C12H10F4N2O
Average molar mass
274.21 g/mol

Names & identifiers

Preferred name
[5-(4-fluoro-3-trifluoromethyl-phenyl)-2-methyl-2H-pyrazol-3-yl]-methanol
IUPAC
[3-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylpyrazol-5-yl]methanol

Names & synonyms

[5-(4-fluoro-3-trifluoromethyl-phenyl)-2-methyl-2H-pyrazol-3-yl]-methanolSCHEMBL5016821

Database identifiers

PubChem CID
69280241

Properties

Computed structural properties

XLogP
2
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
313

Related reactions

3 records
New reaction record
HRID 199709 reaction equation
HRID 199709As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 915461 reaction equation
HRID 915461As productuspto-grants-2007_09
HRID 915462 reaction equation
HRID 915462As reactantuspto-grants-2007_09

Compound notes

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